Impact of Small Adsorbates in the Vibrational Spectra of Mg- and Zn-MOF-74 Revealed by First-Principles Calculations-Reference-Cited by-同舟云学术

Impact of Small Adsorbates in the Vibrational Spectra of Mg- and Zn-MOF-74 Revealed by First-Principles Calculations

Published:2020-11-23 Issue:49 Volume:12 Page:54980-54990
ISSN:1944-8244
Container-title:ACS Applied Materials & Interfaces
language:en
Short-container-title:ACS Appl. Mater. Interfaces

Author:

Romero-Muñiz Carlos¹^ORCID,Gavira-Vallejo José María²,Merkling Patrick J.¹^ORCID,Calero Sofía¹³^ORCID

Affiliation:

1. Department of Physical, Chemical and Natural Systems, Universidad Pablo de Olavide, Ctra. Utrera Km. 1, E-41013 Seville, Spain

2. Departamento de Ciencias y Técnicas Fisicoquímicas, Facultad de Ciencias, Universidad Nacional de Educación a Distancia (UNED), Paseo de la Senda del Rey 9, E-28040 Madrid, Spain

3. Materials Simulation & Modelling, Department of Applied Physics, Eindhoven University of Technology, 5600MB Eindhoven, The Netherlands

Funder

Ministerio de Ciencia e Innovaci?n

Publisher

American Chemical Society (ACS)

Subject

General Materials Science

Link

https://pubs.acs.org/doi/pdf/10.1021/acsami.0c16629

Reference65 articles.

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3. Highly efficient separation of carbon dioxide by a metal-organic framework replete with open metal sites

4. High-Capacity Methane Storage in Metal−Organic Frameworks M2(dhtp): The Important Role of Open Metal Sites

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